[2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3,4-dimethoxy-5-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 3,4-dimethoxy-5-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-(3-morpholinosulfonylanilino)-2-oxo-ethyl] 3,4-dimethoxy-5-(thiophene-2-carbonylamino)benzoate CAS Name: 3,4-dimethoxy-5-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-[3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 3,4-dimethoxy-5-(thiophene-2-carbonylamino)benzoate Traditional Name: 3,4-dimethoxy-5-(2-thenoylamino)benzoic acid [2-keto-2-(3-morpholinosulfonylanilino)ethyl] ester Formula: C26H27N3O9S2 MolecularWeight: 589.63728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)NC(=O)C2=CC=CS2)C(=O)OCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)NC(=O)C2=CC=CS2)C(=O)OCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H27N3O9S2/c1-35-21-14-17(13-20(24(21)36-2)28-25(31)22-7-4-12-39-22)26(32)38-16-23(30)27-18-5-3-6-19(15-18)40(33,34)29-8-10-37-11-9-29/h3-7,12-15H,8-11,16H2,1-2H3,(H,27,30)(H,28,31)